Basic information
- CAS
760995-22-0- Standard SMILES
N#Cc1ccc(-c2n[nH]c3c2Cc2cc(N4CCOCC4)ccc2-3)cc1- InChIKey
DZGWSFUCARILDY-UHFFFAOYSA-N- Molecular formula
- C21H18N4O
- Average molar mass
- 342.4 g/mol
- Monoisotopic mass
- 342.14806121
Names & identifiers
- Preferred name
- 4-[1,4-Dihydro-6-(4-morpholinyl)indeno[1,2-c]pyrazol-3-yl]benzonitrile
- IUPAC
- 4-(6-morpholin-4-yl-1,4-dihydroindeno[2,1-d]pyrazol-3-yl)benzonitrile
Names & synonyms
SCHEMBL4810178DTXSID9011554894-[1,4-Dihydro-6-(4-morpholinyl)indeno[1,2-c]pyrazol-3-yl]benzonitrile4-[6-(Morpholin-4-yl)-1,4-dihydroindeno[1,2-c]pyrazol-3-yl]benzonitrile760995-22-0
Database identifiers
- CAS
760995-22-0- PubChem CID
- 69200057
- DTXSID
DTXSID901155489
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 64.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 545
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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